6-[3-(1-adamantyl)-4-(carboxymethyloxy)phenyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[3-(1-adamantyl)-4-(carboxymethyloxy)phenyl]naphthalene-2-carboxylic acid Openeye Name: 6-[3-(1-adamantyl)-4-(carboxymethyloxy)phenyl]naphthalene-2-carboxylic acid CAS Name: 6-[3-(1-adamantyl)-4-(carboxymethyloxy)phenyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[3-(1-adamantyl)-4-(carboxymethyloxy)phenyl]naphthalene-2-carboxylic acid Traditional Name: 6-[3-(1-adamantyl)-4-(carboxymethyloxy)phenyl]-2-naphthoic acid Formula: C29H28O5 MolecularWeight: 456.52962

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=CC6=C(C=C5)C=C(C=C6)C(=O)O)OCC(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=CC6=C(C=C5)C=C(C=C6)C(=O)O)OCC(=O)O

InChI

InChI=1S/C29H28O5/c30-27(31)16-34-26-6-5-23(21-1-2-22-11-24(28(32)33)4-3-20(22)10-21)12-25(26)29-13-17-7-18(14-29)9-19(8-17)15-29/h1-6,10-12,17-19H,7-9,13-16H2,(H,30,31)(H,32,33)